[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]butan-2-yl]azanium Openeye Name: [(1S)-1-[(4-isopropylphenyl)carbamoyl]-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-(4-propan-2-ylanilino)butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfanyl-1-oxo-1-(4-propan-2-ylanilino)butan-2-yl]azanium Traditional Name: [(1S)-3-(methylthio)-1-(p-cumenylcarbamoyl)propyl]ammonium Formula: C14H23N2OS+ MolecularWeight: 267.41022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C(CCSC)[NH3+]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)[C@H](CCSC)[NH3+]

InChI

InChI=1S/C14H22N2OS/c1-10(2)11-4-6-12(7-5-11)16-14(17)13(15)8-9-18-3/h4-7,10,13H,8-9,15H2,1-3H3,(H,16,17)/p+1/t13-/m0/s1